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CAS 123464-89-1 N-(3R)-1-AZABICYCLO[2.2.2]OCT-3-YL-4-CHLOROBENZAMIDE molecular structure lightbox
CAS RN: 123464-89-1

N-(3R)-1-AZABICYCLO[2.2.2]OCT-3-YL-4-CHLOROBENZAMIDE

Product Availability

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8 package records7 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260316 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250423 10mg In stock Shanghai Inquiry
Batchno.20260131 10mg / 50mg / 250mg / 1g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
Batchno.20250808 1g Out of stock Inquiry
Batchno.20250913 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20250111 250mg In stock Shanghai Inquiry
Batchno.20260624 25mg In stock Shanghai, Wuhan Inquiry
Batchno.20250813 50mg In stock Shanghai, Shenzhen, Wuhan Inquiry
  • Product code: SSC-027198
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 123464-89-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

123464-89-1 / N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-4-chlorobenzamide;hydrochloride

Standard CAS: 123464-89-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
123464-89-1
Multi CAS
No
Molecular Formula
C14H18Cl2N2O
Molecular Weight
301.200000
Exact Mass
300.079619
SMILES
C1CN2CCC1[C@H](C2)NC(=O)C3=CC=C(C=C3)Cl.Cl
InChI
InChI=1S/C14H17ClN2O.ClH/c15-12-3-1-11(2-4-12)14(18)16-13-9-17-7-5-10(13)6-8-17;/h1-4,10,13H,5-9H2,(H,16,18);1H/t13-;/m0./s1
InChIKey
HSEQUIRZHDYOIX-ZOWNYOTGSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
79.12
TPSA
32.34

LogP / Solubility

WLOGP
2.59
MLOGP
2.29
XLogP3
2.59
Consensus LogP
2.49
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.9
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.72

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4.5

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